SCHEMBL9074468

SCHEMBL9074468

Cc1ccc(C2CCC(c3ccc(Oc4ccc(N)cc4C)cc3)(c3ccc(Oc4ccc(N)cc4C)cc3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.38
ALDH1A1 P00352 4/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
MCHR1 Q99705 6/20 0.33
HTR2C P28335 3/20 0.32
HTR2B P41595 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
TRPC6 Q9Y210 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9076164 0.93 TEAD4 (0.41) TEAD4ALDH1A1POLBMAPTTDP1
SCHEMBL9073190 0.91 SLC6A2 (0.38) ALDH1A1POLBMAPTSLC6A2SLC6A4
SCHEMBL9074332 0.89 SLC6A4 (0.35) SLC6A2SLC6A4SLC6A3SMN1; SMN2MCHR1
SCHEMBL9075126 0.89 TEAD4 (0.36) TEAD4ALDH1A1POLBMAPTTDP1
SCHEMBL9074907 0.88 ALDH1A1 (0.39) TEAD4ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL9073901 0.87 SLC6A2 (0.34) ALDH1A1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL9280585 0.86 TEAD4 (0.53) TEAD4ALDH1A1POLBMAPTTDP1
SCHEMBL9075446 0.86 SLC6A4 (0.35) TEAD4ALDH1A1POLBMAPTTDP1
SCHEMBL9075444 0.85 SPHK1 (0.39)
SCHEMBL9075637 0.85 SPHK1 (0.43)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545444-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1996-08-13 US disclosed
US-5430195-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-07-04 US disclosed
US-5414126-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-05-09 US disclosed